SpectraBase Spectrum ID |
FZJiway6VdK |
Name |
1,1'-Bicyclohexyl, 2-(1-methylethyl)-, cis- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
208.219100902 u |
Formula |
C15H28 |
InChI |
InChI=1S/C15H28/c1-12(2)14-10-6-7-11-15(14)13-8-4-3-5-9-13/h12-15H,3-11H2,1-2H3/t14-,15+/m0/s1 |
InChIKey |
XWULVJMSQHXLOJ-LSDHHAIUSA-N |
Molecular Weight |
208.389 g/mol |
SMILES |
CC(C)[C@]1([C@](CCCC1)(C1CCCCC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943371 |